缓激肽氯甲基酮
TL;DR: 缓激肽氯甲基酮 (CAS 86807-97-8) is a chemical compound with molecular formula C51H77Cl4N15O10 and molecular weight 1199.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
缓激肽氯甲基酮
1-[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-N-[2-[[1-[[1-[2-[[1-[[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide;trihydrochloride
Also Known As: Bradykinin chloromethyl ketone, 1-[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-N-[2-[[1-[[1-[2-[[1-[[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide trihydrochloride, Bradykinin, 8-(N-(4-((aminoiminomethyl)amino)-1-(chloroacetyl)butyl)-L-phenylalaninamide)-9-de-L-arginine-, trihydrochloride, (S)-
| Molecular Formula | C51H77Cl4N15O10 |
|---|---|
| Molecular Weight | 1199.47 g/mol |
| LogP | -1.9997 |
| Topological Polar Surface Area | 399.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 28 |
| Exact Mass | 1199.4731 |
| Heavy Atoms | 80 |
| Complexity | 2100.0 |
Chemical Identifiers
| CAS Number | 86807-97-8 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CCCN=C(N)N)N)C(=O)NCC(=O)NC(CC3=CC=CC=C3)C(=O)NC(CO)C(=O)N4CCCC4C(=O)NC(CC5=CC=CC=C5)C(=O)NC(CCCN=C(N)N)C(=O)CCl.Cl.Cl.Cl |
| InChIKey | BJJKGUMJXWAHRS-UHFFFAOYSA-N |
Product Overview
缓激肽氯甲基酮 (CAS 86807-97-8), with molecular formula C51H77Cl4N15O10 and molecular weight 1199.47 g/mol. IUPAC: 1-[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]-N-[2-[[1-[[1-[2-[[1-[[1-chloro-6-(diaminomethylideneamino)-2-oxohexan-3-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamoyl]pyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide;trihydrochloride.
Chemical Property Profile of 缓激肽氯甲基酮
Property Insights of 缓激肽氯甲基酮
The XLogP value of -1.9997 indicates that 缓激肽氯甲基酮 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 399.0 Ų indicates high polarity, suggesting 缓激肽氯甲基酮 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 缓激肽氯甲基酮 has 14 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 缓激肽氯甲基酮?
The CAS number of 缓激肽氯甲基酮 is 86807-97-8.
What is the molecular formula of 缓激肽氯甲基酮?
The molecular formula of 缓激肽氯甲基酮 is C51H77Cl4N15O10.
What is the molecular weight of 缓激肽氯甲基酮?
The molecular weight of 缓激肽氯甲基酮 is 1199.47 g/mol.
Where can I buy 缓激肽氯甲基酮?
You can request a quote for 缓激肽氯甲基酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 缓激肽氯甲基酮?
Yes, KEHONG BIO provides custom synthesis services for 缓激肽氯甲基酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.